Chelidonine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00614
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00614 contains the MS2 mass spectrum of Chelidonine with the InChIkey GHKISGDRQRSCII-ZOCIIQOWSA-N.
Source: Chelidonine
Chemical Info
| InChI | InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1 |
|---|---|
| SMILES | CN1CC2=C(C=CC3=C2OCO3)[C@@H]4[C@H]1C5=CC6=C(C=C5C[C@@H]4O)OCO6 |
| InChI Key | GHKISGDRQRSCII-ZOCIIQOWSA-N |
| Molecular Formula | C20H19NO5 |
| Exact Mass | 353.126 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | c2cee33f-6b3e-4cdd-8796-68e6a2226008 |
| Package id | msbnk-washington_state_univ-bml00614 |
| Resource type | HTML |
| State | active |